(3Z)-Phycoerythrobilin

Molecular Formula: C33H38N4O6


InChI: InChI=1/C33H38N4O6/c1-7-20-19(6)32(42)37-27(20)14-25-18(5)23(10-12-31(40)41)29(35-25)15-28-22(9-11-30(38)39)17(4)24(34-28)13-26-16(3)21(8-2)33(43)36-26/h7-8,14-15,19,26,34-35H,2,9-13H2,1,3-6H3,(H,36,43)(H,38,39)(H,40,41)/b20-7-,25-14-,29-15-/t19-,26-/m1/s1/f/h36,38,40H

InChIKey: InChIKey=GLWKVDXAQHCAIO-GMNBSTRWDT
SMILES: CC=C1C(C(=O)N=C1C=C2C(=C(C(=CC3=C(C(=C(N3)CC4C(=C(C(=O)N4)C=C)C)C)CCC(=O)O)N2)CCC(=O)O)C)C

Names:
    C05912
    (3Z)-Phycoerythrobilin
    3-[2-[(Z)-[(5Z)-3-(2-carboxyethyl)-5-[[(3Z,4R)-3-ethylidene-4-methyl-5-oxo-pyrrol-2-yl]methylidene]-4-methyl-pyrrol-2-ylidene]methyl]-5-[[(2R)-4-ethenyl-3-methyl-5-oxo-1,2-dihydropyrrol-2-yl]methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid

Registries:
    PubChem CID 11953875
    PubChem ID 8200